4-[(5,6-dimethylbenzotriazol-1-yl)methyl]benzoate

Systemtic Name: 4-[(5,6-dimethylbenzotriazol-1-yl)methyl]benzoate Openeye Name: 4-[(5,6-dimethylbenzotriazol-1-yl)methyl]benzoate CAS Name: 4-[(5,6-dimethyl-1-benzotriazolyl)methyl]benzoate IUPAC Name: 4-[(5,6-dimethylbenzotriazol-1-yl)methyl]benzoate Traditional Name: 4-[(5,6-dimethylbenzotriazol-1-yl)methyl]benzoate Formula: C16H14N3O2- MolecularWeight: 280.30126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(N=N2)CC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1C)N(N=N2)CC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C16H15N3O2/c1-10-7-14-15(8-11(10)2)19(18-17-14)9-12-3-5-13(6-4-12)16(20)21/h3-8H,9H2,1-2H3,(H,20,21)/p-1